Geometry & MOs

Info

ID:	71949
PubChem CID:	48415649
Reduced:	SO2N4C21H22 (1)
Stoich.:	AB2C4D21E22 (1)
Weight, g/mol:	329.133969
ΔH_f, kcal/mol:	-14.56
Dipole, Da:	2.77
IP(EA), eV:	-8.5(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-2,5-difluoro-N-methylbenzamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)CN3C(=O)CSC4=CC=CC=C43

DOS

IR

Vibrations